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Home > Nitro Compounds > 88067-67-8
88067-67-8 | 4-Quinolinecarboxamide, N-(2-nitrophenyl)-2-phenyl-
CAS No: 88067-67-8 Catalog No: AG004I0D MDL No:
Product Description
Catalog Number:
AG004I0D
Chemical Name:
4-Quinolinecarboxamide, N-(2-nitrophenyl)-2-phenyl-
CAS Number:
88067-67-8
Molecular Formula:
C22H15N3O3
Molecular Weight:
369.3728
IUPAC Name:
N-(2-nitrophenyl)-2-phenylquinoline-4-carboxamide
InChI:
InChI=1S/C22H15N3O3/c26-22(24-19-12-6-7-13-21(19)25(27)28)17-14-20(15-8-2-1-3-9-15)23-18-11-5-4-10-16(17)18/h1-14H,(H,24,26)
InChI Key:
CZZUTHBFQNIPSH-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccccc1NC(=O)c1cc(nc2c1cccc2)c1ccccc1
Properties
Complexity:
558
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
369.111g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
369.38g/mol
Monoisotopic Mass:
369.111g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
87.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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